5-[3-methoxy-4-[3-[4-(2-methylphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenyl]-6-methyl-2-oxidanylidene-1H-pyridine-3-carbonitrile

Systemtic Name: 5-[3-methoxy-4-[3-[4-(2-methylphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]phenyl]-6-methyl-2-oxidanylidene-1H-pyridine-3-carbonitrile Openeye Name: 5-[4-[2-hydroxy-3-[4-(o-tolyl)piperazin-1-yl]propoxy]-3-methoxy-phenyl]-6-methyl-2-oxo-1H-pyridine-3-carbonitrile CAS Name: 5-[4-[2-hydroxy-3-[4-(2-methylphenyl)-1-piperazinyl]propoxy]-3-methoxyphenyl]-6-methyl-2-oxo-1H-pyridine-3-carbonitrile IUPAC Name: 5-[4-[2-hydroxy-3-[4-(2-methylphenyl)piperazin-1-yl]propoxy]-3-methoxyphenyl]-6-methyl-2-oxo-1H-pyridine-3-carbonitrile Traditional Name: 5-[4-[2-hydroxy-3-[4-(o-tolyl)piperazino]propoxy]-3-methoxy-phenyl]-2-keto-6-methyl-1H-pyridine-3-carbonitrile Formula: C28H32N4O4 MolecularWeight: 488.57808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)CC(COC3=C(C=C(C=C3)C4=C(NC(=O)C(=C4)C#N)C)OC)O

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)CC(COC3=C(C=C(C=C3)C4=C(NC(=O)C(=C4)C#N)C)OC)O

InChI

InChI=1S/C28H32N4O4/c1-19-6-4-5-7-25(19)32-12-10-31(11-13-32)17-23(33)18-36-26-9-8-21(15-27(26)35-3)24-14-22(16-29)28(34)30-20(24)2/h4-9,14-15,23,33H,10-13,17-18H2,1-3H3,(H,30,34)